CHEBI:153860 - N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5S)-4-[(2S,3R,4R,5S,6R)-3-Acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,2,5,6-tetrahydroxyhexan-3-yl]oxy-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide

ChEBI IDCHEBI:153860
ChEBI NameN-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5S)-4-[(2S,3R,4R,5S,6R)-3-Acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,2,5,6-tetrahydroxyhexan-3-yl]oxy-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC34H60N2O26
Net Charge0
Average Mass912.842
Monoisotopic Mass912.34343
SMILESCC(=O)N[C@H]1[C@H](O[C@H]([C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@@H](O)CO)[C@H](O)CO)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O
WURCSWURCS=2.0/3,5,4/[h2112h][a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-3-2-3/a3-b1_a4-d1_b4-c1_d4-e1
InChIInChI=1S/C34H60N2O26/c1-9(43)35-17-21(49)29(61-33-25(53)23(51)19(47)13(5-39)55-33)15(7-41)57-31(17)59-27(11(45)3-37)28(12(46)4-38)60-32-18(36-10(2)44)22(50)30(16(8-42)58-32)62-34-26(54)24(52)20(48)14(6-40)56-34/h11-34,37-42,45-54H,3-8H2,1-2H3,(H,35,43)(H,36,44)/t11-,12+,13-,14-,15-,16-,17-,18-,19+,20+,21-,22-,23+,24+,25-,26-,27+,28-,29-,30-,31+,32+,33+,34+/m1/s1
InChIKeyZDSKUIPRARYJOH-YGFOSRARSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5S)-4-[(2S,3R,4R,5S,6R)-3-Acetamido-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-1,2,5,6-tetrahydroxyhexan-3-yl]oxy-4-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide (CHEBI:153860) is a oligosaccharide (CHEBI:50699)
Manual XrefsDatabases
G74862XXGlyTouCan
G74862XXGlyGen